Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2B | Q13224 | 2/20 | 0.57 |
| ▸ | CRBN | Q96SW2 | 5/20 | 0.50 |
| ▸ | HTR1A | P08908 | 2/20 | 0.50 |
| ▸ | HTR2A | P28223 | 2/20 | 0.50 |
| ▸ | HTR7 | P34969 | 2/20 | 0.50 |
| ▸ | DRD3 | P35462 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | DRD4 | P21917 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | DRD2 | P14416 | 1/20 | 0.45 |
| ▸ | HTR2C | P28335 | 1/20 | 0.45 |
| ▸ | HTR2B | P41595 | 1/20 | 0.45 |
| ▸ | SMYD3 | Q9H7B4 | 5/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7349822 | 0.98 | GRIN2B (0.55) | GRIN2BCRBNHTR1AHTR2AHTR7 | |
| SCHEMBL9825056 | 0.89 | GRIN2B (0.56) | GRIN2BCRBNHTR1AHTR2AHTR7 | |
| Hydrochloric Acid SCHEMBL9825181 | 0.88 | GRIN2B (0.55) | GRIN2BCRBNHTR1AHTR2AHTR7 | |
| Hydrochloric Acid SCHEMBL11255645 | 0.88 | GRIN2B (0.57) | GRIN2BCRBNHTR1AHTR2AHTR7 | |
| Hydrochloric Acid SCHEMBL10838416 | 0.85 | GRIN2B (0.55) | GRIN2BCRBNHTR1AHTR2AHTR7 | |
| SCHEMBL7341674 | 0.82 | ALDH1A1 (0.53) | GRIN2BCRBNHTR1AHTR2AHTR7 | |
| Hydrochloric Acid SCHEMBL7351252 | 0.81 | ALDH1A1 (0.72) | GRIN2BCRBNHTR1AHTR2AHTR7 | |
| SCHEMBL8440778 | 0.81 | GRIN2B (0.53) | GRIN2BCRBNHTR1AHTR2AHTR7 | |
| SCHEMBL7286616 | 0.81 | CRBN (0.59) | CRBNHTR1AHTR2AHTR7DRD3 | |
| SCHEMBL7288177 | 0.80 | GRIN2B (0.57) | GRIN2BCRBNHTR1AHTR2AHTR7 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4514401-A | CARDIOTONICS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1985-04-30 | — | — | US | disclosed |